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The molecular formula of 3-Chlorohexahydro-3-methyl-3H-benzofuran-2-one is C9H13ClO2.
It was created on August 20, 2009, and last modified on December 30, 2023.
The IUPAC name is 3-chloro-3-methyl-3a,4,5,6,7,7a-hexahydro-1-benzofuran-2-one.
The InChIKey is CBIKLWCRTLLKFI-UHFFFAOYSA-N.
It has 2 hydrogen bond acceptors.
The molecular weight is 188.65 g/mol.
It has 0 rotatable bonds.
The topological polar surface area is 26.3 Ų.
It has 0 defined atom stereocenters.
Yes, the compound is canonicalized in PubChem.
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